2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride

C10H14Cl2N2O2 — CID 141116458

IUPAC2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride
SMILESCC(C)Oc1ncc(C(=O)CN)cc1Cl.Cl
InChIInChI=1S/C10H13ClN2O2.ClH/c1-6(2)15-10-8(11)3-7(5-13-10)9(14)4-12;/h3,5-6H,4,12H2,1-2H3;1H
InChIKeyDUFFLKDFFXZMFW-UHFFFAOYSA-N
MW265.14 g/mol
LogP2.09
Rot. Bonds4

About 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride

2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride (PubChem CID 141116458) has the molecular formula C10H14Cl2N2O2 and a molecular weight of 265.14 g/mol. Its IUPAC name is 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride
PubChem CID141116458
Molecular FormulaC10H14Cl2N2O2
Molecular Weight265.14 g/mol
Exact Mass264.04
IUPAC Name2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride
SMILESCC(C)Oc1ncc(C(=O)CN)cc1Cl.Cl
InChIInChI=1S/C10H13ClN2O2.ClH/c1-6(2)15-10-8(11)3-7(5-13-10)9(14)4-12;/h3,5-6H,4,12H2,1-2H3;1H
InChIKeyDUFFLKDFFXZMFW-UHFFFAOYSA-N
XLogP2.09
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.14
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(3-hydroxypropyl)-6-propan-2-yloxypyridine-3-carboxamide
CID 78904618
5-chloro-N-(1-cyclopropylethyl)-6-propan-2-yloxypyridine-3-carboxamide
CID 75415942
6-butan-2-yloxy-5-chloropyridine-3-carboxylic acid
CID 60903616
N-(2-tert-butylsulfanylethyl)-5-chloro-6-propan-2-yloxypyridine-3-carboxamide
CID 86883963
5-chloro-N-methyl-6-propan-2-yloxy-N-[[4-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 55854345
3-chloro-5-ethyl-2-propan-2-yloxypyridine
CID 90064685
5-chloro-N-(4-methyl-1,3-thiazol-2-yl)-6-propan-2-yloxypyridine-3-carboxamide
CID 47293511
methyl 1-[(5-chloro-6-propan-2-yloxypyridine-3-carbonyl)amino]cyclohexane-1-carboxylate
CID 55870839
2-[(5-chloro-6-propan-2-yloxypyridine-3-carbonyl)-(oxan-4-yl)amino]acetic acid
CID 126775677
(3R,6S)-1-(5-chloro-6-propan-2-yloxypyridine-3-carbonyl)-6-methylpiperidine-3-carboxamide
CID 95584937
3-(5-chloro-6-propan-2-yloxy-3-pyridinyl)-3-oxo-2-pyridin-2-ylpropanenitrile
CID 84593922
2-amino-1-(6-chloro-3-pyridinyl)ethanone;hydrochloride
CID 88879940

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride?
The IUPAC name of 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride (CID 141116458) is 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride.
What is the SMILES notation for 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride?
The canonical SMILES for 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride is CC(C)Oc1ncc(C(=O)CN)cc1Cl.Cl.
What is the InChIKey of 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride?
The InChIKey is DUFFLKDFFXZMFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2.ClH/c1-6(2)15-10-8(11)3-7(5-13-10)9(14)4-12;/h3,5-6H,4,12H2,1-2H3;1H.
What are the key properties of 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride?
2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride has a molecular weight of 265.14 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(5-chloro-6-propan-2-yloxy-3-pyridinyl)ethanone;hydrochloride is sourced from PubChem (CID 141116458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).